SCHEMBL16110875

SCHEMBL16110875

COC(=O)CCC12CCC(O)(CC1)C2

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.43
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 3/20 0.33
CA12 O43570 1/20 0.33
CA14 Q9ULX7 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 3/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
GLA P06280 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16111259 0.89 TSHR (0.46) TSHRKMT2AMEN1LMNACA12
SCHEMBL16111260 0.76 TSHR (0.44) TSHRKMT2AMEN1LMNACA12
SCHEMBL15550819 0.76 TSHR (0.44) TSHRKMT2AMEN1LMNACA12
SCHEMBL16137831 0.75 HSD11B1 (0.32) TSHRHSD17B10
SCHEMBL7943512 0.74 TSHR (0.43) TSHRKMT2AMEN1LMNACA12
SCHEMBL13698866 0.74 TSHR (0.43) TSHRKMT2AMEN1LMNACA12
SCHEMBL13698867 0.74 TSHR (0.43) TSHRKMT2AMEN1LMNACA12
Hydrochloric Acid SCHEMBL20542075 0.72 TSHR (0.44) TSHRKMT2AMEN1LMNACA12
SCHEMBL16110652 0.71 TSHR (0.40) TSHRKMT2AMEN1LMNACA12
SCHEMBL16111573 0.71 TSHR (0.40) TSHRKMT2AMEN1LMNACA12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970092-B1 BICYCLO [2.2.1]ACID GPR120 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2016-12-14 EP disclosed
EP-2970092-B1 BICYCLO [2.2.1]ACID GPR120 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2016-12-14 EP disclosed
US-9518000-B2 Bicyclo [2.2.1] acid GPR120 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2016-12-13 US disclosed
US-9518000-B2 Bicyclo [2.2.1] acid GPR120 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2016-12-13 US disclosed
US-9518000-B2 Bicyclo [2.2.1] acid GPR120 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2016-12-13 US disclosed
US-20160016880-A1 BICYCLO [2.2.1] ACID GPR120 MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2016-01-21 US disclosed
US-20160016880-A1 BICYCLO [2.2.1] ACID GPR120 MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2016-01-21 US disclosed
US-20160016880-A1 BICYCLO [2.2.1] ACID GPR120 MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2016-01-21 US disclosed
EP-2970092-A2 BICYCLO [2.2.1]ACID GPR120 MODULATORS Bristol-Myers Squibb Company (US) 2016-01-20 EP disclosed
WO-2014159794-A2 BICYCLO [2.2.1] ACID GPR120 MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-10-02 WO disclosed
WO-2014159794-A2 BICYCLO [2.2.1] ACID GPR120 MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-10-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160016880-A1 BICYCLO [2.2.1] ACID GPR120 MODULATORS GPR180, GPR88, GPBAR1 TSHR 1155/4885KMT2A 3046/4885MEN1 4244/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.